1-(4-chlorophenyl)-4,4-dimethyl-1-oxidanyl-2-(1,2,4-triazol-1-yl)pentan-3-one

Systemtic Name: 1-(4-chlorophenyl)-4,4-dimethyl-1-oxidanyl-2-(1,2,4-triazol-1-yl)pentan-3-one Openeye Name: 1-(4-chlorophenyl)-1-hydroxy-4,4-dimethyl-2-(1,2,4-triazol-1-yl)pentan-3-one CAS Name: 1-(4-chlorophenyl)-1-hydroxy-4,4-dimethyl-2-(1,2,4-triazol-1-yl)-3-pentanone IUPAC Name: 1-(4-chlorophenyl)-1-hydroxy-4,4-dimethyl-2-(1,2,4-triazol-1-yl)pentan-3-one Traditional Name: 1-(4-chlorophenyl)-1-hydroxy-4,4-dimethyl-2-(1,2,4-triazol-1-yl)pentan-3-one Formula: C15H18ClN3O2 MolecularWeight: 307.77532

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)C(C(C1=CC=C(C=C1)Cl)O)N2C=NC=N2

Isomeric SMILES

CC(C)(C)C(=O)C(C(C1=CC=C(C=C1)Cl)O)N2C=NC=N2

InChI

InChI=1S/C15H18ClN3O2/c1-15(2,3)14(21)12(19-9-17-8-18-19)13(20)10-4-6-11(16)7-5-10/h4-9,12-13,20H,1-3H3